1-(4-bromophenyl)-2-[5-(hydroxymethyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[5-(hydroxymethyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-bromophenyl)-2-[5-(hydroxymethyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-(hydroxymethyl)-1-methyl-2-imidazolyl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[5-(hydroxymethyl)-1-methylimidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-bromophenyl)-2-[(1-methyl-5-methylol-imidazol-2-yl)thio]ethanone Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)C2=CC=C(C=C2)Br)CO

Isomeric SMILES

CN1C(=CN=C1SCC(=O)C2=CC=C(C=C2)Br)CO

InChI

InChI=1S/C13H13BrN2O2S/c1-16-11(7-17)6-15-13(16)19-8-12(18)9-2-4-10(14)5-3-9/h2-6,17H,7-8H2,1H3